CID 146050304

2413899-02-0

Structural Information

Molecular Formula
C12H20N4O2
SMILES
CC1CNC2=C(C=NN2C1)NC(=O)OC(C)(C)C
InChI
InChI=1S/C12H20N4O2/c1-8-5-13-10-9(6-14-16(10)7-8)15-11(17)18-12(2,3)4/h6,8,13H,5,7H2,1-4H3,(H,15,17)
InChIKey
HDFXJOFQNAASAH-UHFFFAOYSA-N
Compound name
tert-butyl N-(6-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.15863 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.16591 158.9
[M+Na]+ 275.14785 166.9
[M+NH4]+ 270.19245 164.3
[M+K]+ 291.12179 165.4
[M-H]- 251.15135 157.2
[M+Na-2H]- 273.13330 160.5
[M]+ 252.15808 159.0
[M]- 252.15918 159.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.